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Fluorine in PDB, part 147 (files: 5841-5880), PDB 6nvj-6ode

Experimental structures of coordination spheres of Fluorine (F) in bioorganic molecules from X-Ray and NMR experiments. Coordination spheres were calculated with 5.0 Angstroms radius around Fluorine atoms. PDB files: 5841-5880 (PDB 6nvj-6ode).
  1. 6nvj (F: 1) - FGFR4 Complex with N-(2-((5-((2,6-Dichloro-3,5-Dimethoxybenzyl)Oxy) Pyrimidin-2-Yl)Amino)-3-Fluorophenyl)Acrylamide
    Other atoms: Cl (2);
  2. 6nwk (F: 1) - Structure of the Ancestral Glucocorticoid Receptor 2 Ligand Binding Domain in Complex with Dexamethasone and PGC1A Coregulator Fragment
  3. 6nws (F: 4) - Rorgamma Ligand Binding Domain
    Other atoms: Cl (1);
  4. 6nwt (F: 14) - Rorgamma Ligand Binding Domain
  5. 6nwu (F: 3) - Rorgamma Ligand Binding Domain
    Other atoms: Cl (2);
  6. 6nx1 (F: 20) - Structure of Human Pregnane X Receptor Ligand Binding Domain Bound Tethered with Src Co-Activator Peptide and Compound-3 Aka 1,1,1,3,3, 3-Hexafluoro-2-{4-[1-(4- Luorobenzenesulfonyl) Cyclopentyl]Phenyl}Propan-2-Ol
  7. 6nyb (F: 1) - Structure of A Mapk Pathway Complex
    Other atoms: Mg (1); Zn (2); I (1);
  8. 6nyw (F: 1) - Structure of Spastin Aaa Domain N527C Mutant in Complex with 8- Fluoroquinazoline-Based Inhibitor
  9. 6nze (F: 2) - Crystal Structure of Tyrosine Kinase 2 JH2 (Pseudo Kinase Domain) Complexed with COMPOUND_5 Aka 4-[(2-Carbamoylphen Yl)Amino]-6-[(5- Fluoropyridin-2-Yl)Amino]-N-Methylpyridine -3-Carboxamide
  10. 6nzf (F: 2) - Crystal Structure of Tyrosine Kinase 2 JH2 (Pseudo Kinase Domain) Complexed with COMPOUND_5 Aka 4-[(2-Carbamoylphen Yl)Amino]-6-[(5- Fluoropyridin-2-Yl)Amino]-N-Methylpyridine -3-Carboxamide
  11. 6nzm (F: 2) - Brutons Tyrosine Kinase in Complex with Compound 50.
  12. 6nzq (F: 2) - Crystal Structure of Tyrosine Kinase 2 JH2 (Pseudo Kinase Domain) Complexed with COMPOUND_29 Aka 6-[(5-Fluoro-4-Meth Ylpyridin-2-Yl) Amino]-4-({2-Methoxy-3-[(Pyridin-2-Ylmethyl )Carbamoyl]Phenyl}Amino)- N-Methylpyridine-3-Carboxamide
  13. 6nzt (F: 4) - Crystal Structure of Hcv NS3/4A Protease in Complex with Voxilaprevir
    Other atoms: Zn (1);
  14. 6nzv (F: 2) - Crystal Structure of Hcv NS3/4A Protease in Complex with Compound 12
    Other atoms: Zn (1);
  15. 6o0h (F: 8) - Cryo-Em Structure of Human Atp-Citrate Lyase in Complex with Inhibitor Ndi-091143
    Other atoms: Cl (4);
  16. 6o1h (F: 3) - Tryptophan Synthase Q114A Mutant in Complex with N-(4'- Trifluoromethoxybenzenesulfonyl)-2-Amino-1-Ethylphosphate (F9F) at the Enzyme Alpha-Site, Cesium Ion at the Metal Coordination Site, and 2-Aminophenol Quinonoid at the Enzyme Beta Site
    Other atoms: Cs (5); Cl (24);
  17. 6o3c (F: 2) - Crystal Structure of Active Smoothened Bound to SAG21K, Cholesterol, and NBSMO8
    Other atoms: Cl (1); Na (1);
  18. 6o3f (F: 6) - Crystal Structure of Lysyl-Trna Synthetase From Chlamydia Trachomatis with Complexed with L-Lysine and A Difluoro Cyclohexyl Chromone Ligand
  19. 6o3i (F: 2) - Crystal Structure of Human IDO1 Bound to Navoximod (Nlg-919)
    Other atoms: Fe (2);
  20. 6o3z (F: 1) - Crystal Structure of Rorgt with 3-Cyano-N-(3-{[(3S)-4- (Cyclopentanecarbonyl)-3-Methylpiperazin-1-Yl]Methyl}-5-Fluoro-2- Methylphenyl)Benzamide (Compound 1)
  21. 6o5i (F: 3) - Menin in Complex with Mi-3454
  22. 6o5y (F: 3) - Structure of Human Cytochrome P450 1A1 with 5-Amino-N-(5-((4R,5R)-4- Amino-5-Fluoroazepan-1-Yl)-1-Methyl-1H-Pyrazol-4-Yl)-2-(2,6- Difluorophenyl)Thiazole-4-Carboxamide)
    Other atoms: Fe (4);
  23. 6o72 (F: 24) - Structure of the TRPM8 Cold Receptor By Single Particle Electron Cryo- Microscopy, Tc-I 2014-Bound State
    Other atoms: Na (8);
  24. 6o8i (F: 1) - Btk in Complex with Inhibitor
  25. 6o91 (F: 10) - Horse Liver L57F Alcohol Dehydrogenase Complexed with Nad and Pentafluorobenzyl Alcohol
    Other atoms: Zn (4);
  26. 6o98 (F: 14) - Crystal Structure of Rar-Related Orphan Receptor C in Complex with A Phenyl (3-Phenylpyrrolidin-3-Yl)Sulfone Inhibitor
  27. 6o9o (F: 3) - Crystal Structure of SMYD3 with Potent and Selective Isoxazole Amide Inhibitor 1
    Other atoms: Mg (2); Zn (3);
  28. 6oa7 (F: 6) - Horse Liver L57F Alcohol Dehydrogenase E Complexed with Nad and Trifluoroethanol
    Other atoms: Zn (4);
  29. 6oaa (F: 18) - CDC48-NPL4 Complex Processing Poly-Ubiquitinated Substrate in the Presence of Adp-Befx, State 1
  30. 6oab (F: 24) - CDC48-NPL4 Complex Processing Poly-Ubiquitinated Substrate in the Presence of Adp-Befx, State 2
  31. 6oac (F: 2) - PQR530 [(S)-4-(Difluoromethyl)-5-(4-(3-Methylmorpholino)-6-Morpholino- 1,3,5-Triazin-2-Yl)Pyridin-2-Amine] Bound to the PI3KA Catalytic Subunit P110ALPHA
  32. 6oaq (F: 3) - Crystal Structure of A Dual Sensor Histidine Kinase in BEF3- Bound State
    Other atoms: Mg (4);
  33. 6oc0 (F: 3) - Crystal Structure of Human Dhodh with Osu-03012
  34. 6oc1 (F: 4) - Crystal Structure of Human Dhodh with Tak-632
  35. 6ocq (F: 2) - Crystal Structure of RIP1 Kinase in Complex with A Pyrrolidine
  36. 6ocw (F: 28) - Crystal Structure of Mycobacterium Tuberculosis Proteasome in Complex with Phenylimidazole-Based Inhibitor A85
  37. 6ocz (F: 28) - Crystal Structure of Mycobacterium Tuberculosis Proteasome in Complex with Phenylimidazole-Based Inhibitor A86
  38. 6od6 (F: 3) - Structure of Bace-1 in Complex with Ligand 13
  39. 6oda (F: 9) - Crystal Structure of HDAC8 in Complex with Compound 2
    Other atoms: K (6); Zn (3);
  40. 6ode (F: 14) - Crystal Structure of Mycobacterium Tuberculosis Proteasome in Complex with Phenylimidazole-Based Inhibitor B6
Page generated: Tue Dec 1 09:28:09 2020

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